7CQX
GmaS/ADP complex-Conformation 2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-03-29 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 113.446, 177.555, 190.524 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.737 - 2.301 |
| R-factor | 0.178 |
| Rwork | 0.176 |
| R-free | 0.21130 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7cql |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.094 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.6.4_486) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.380 |
| High resolution limit [Å] | 2.300 | 4.950 | 2.300 |
| Rmerge | 0.136 | 0.088 | 0.503 |
| Rmeas | 0.142 | 0.092 | 0.524 |
| Rpim | 0.039 | 0.026 | 0.146 |
| Total number of observations | 1141608 | ||
| Number of reflections | 85255 | 8861 | 8432 |
| <I/σ(I)> | 4.7 | ||
| Completeness [%] | 100.0 | 100 | 100 |
| Redundancy | 13.4 | 12.8 | 12.6 |
| CC(1/2) | 0.975 | 0.949 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 0.1 M MES (pH 6.5), 1 M lithium sulfate |
